(E)-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethenesulfonic acid

Systemtic Name: (E)-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethenesulfonic acid Openeye Name: (E)-2-(3,5-dimethylisoxazol-4-yl)ethenesulfonic acid CAS Name: (E)-2-(3,5-dimethyl-4-isoxazolyl)ethenesulfonic acid IUPAC Name: (E)-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethenesulfonic acid Traditional Name: (E)-2-(3,5-dimethylisoxazol-4-yl)ethenesulfonic acid Formula: C7H9NO4S MolecularWeight: 203.21566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C=CS(=O)(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C)/C=C/S(=O)(=O)O

InChI

InChI=1S/C7H9NO4S/c1-5-7(6(2)12-8-5)3-4-13(9,10)11/h3-4H,1-2H3,(H,9,10,11)/b4-3+